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292389

Sigma-Aldrich

2-Bromoheptane

technical grade

Synonym(s):

1-Methylhexyl bromide

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About This Item

Linear Formula:
CH3CH2CH2CH2CH2CHBrCH3
CAS Number:
1974-04-5
Molecular Weight:
179.10
Beilstein/REAXYS Number:
1731556
EC Number:
217-824-3
MDL number:
MFCD00000164
UNSPSC Code:
12352100
PubChem Substance ID:
24857582
NACRES:
NA.22

grade

technical grade

Quality Level

100

refractive index

n20/D 1.447 (lit.)

bp

64-66 °C/21 mmHg (lit.)

density

1.142 g/mL at 25 °C (lit.)

functional group

alkyl halide
bromo

SMILES string

CCCCCC(C)Br

InChI

1S/C7H15Br/c1-3-4-5-6-7(2)8/h7H,3-6H2,1-2H3

InChI key

HLAUCEOFCOXKNF-UHFFFAOYSA-N

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Application

2-Bromoheptane has been used in the preparation of:
  • racemic alcohol, 2-methylheptanol
  • glutathione (GSH) derivatives
  • GSH analog that contains tetrazole isostere (Tet-sHep)

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

129.2 °F - closed cup

flash_point_c

54 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
MKCS9629
MKCG8089
MKCC3034
MKBT0078V
MKBN9012V

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J Boruwa et al.
Bioorganic & medicinal chemistry letters, 14(13), 3571-3574 (2004-06-05)
The absolute stereochemistry of the new antifungal and antibacterial antibiotic produced by Streptomyces sp.201 has been established by achieving the total synthesis of the product. A series of analogues have also been synthesized by changing the side chain and their
Danny Burg et al.
Bioorganic & medicinal chemistry letters, 12(12), 1579-1582 (2002-06-01)
Glutathione (GSH) conjugates inhibit enzymes that are involved in drug metabolism and drug resistance, but their cellular uptake is very low. To improve membrane-permeability, we synthesized a novel GSH-conjugate analogue with a tetrazole carboxylate isostere at the glycine position. Introduction

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